data_2cwp_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2cwp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 4' ' ' MET . . . . . 0.525 ' N ' ' SD ' ' A' ' 4' ' ' MET . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.14 0.495 . . . . 91.15 111.796 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 47.44 109.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 115.806 1.78 . . . . 68.45 115.806 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -117.37 132.88 56.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.918 -1.141 . . . . 49.99 107.918 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -108.85 170.33 8.11 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.996 1.11 . . . . 67.34 113.996 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -95.38 143.67 26.55 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.467 -0.788 . . . . 75.64 110.404 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 36.0 t -51.9 -43.7 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.843 1.053 . . . . 58.45 113.843 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.64 -30.99 69.11 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.6 -0.44 . . . . 61.43 109.996 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 26.9 tp10 -67.56 -41.14 84.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.979 -1.119 . . . . 63.0 107.979 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -64.41 -48.27 76.03 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 108.395 -0.965 . . . . 40.58 108.395 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TRP . . . . . 0.479 ' CH2' ' OXT' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -52.86 -19.03 2.23 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 115.372 1.619 . . . . 54.63 115.372 -178.833 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -72.66 -26.1 61.52 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 118.521 -1.272 . . . . 66.63 110.794 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -79.72 142.85 35.08 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.427 -1.323 . . . . 43.87 107.427 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -115.72 117.56 30.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 114.144 1.164 . . . . 54.61 114.144 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' MET . . . . . . . . . . . . . 64.9 mtm -113.08 136.12 53.05 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.509 -2.034 . . . . 28.49 105.509 178.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -137.52 158.5 44.26 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.146 -0.687 . . . . 47.49 109.146 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 55.9 t -78.64 131.82 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 N-CA-C 106.651 -1.611 . . . . 23.62 106.651 178.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.64 143.61 15.3 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.269 -0.967 . . . . 27.26 112.019 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.8 tp -98.24 123.94 42.58 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.177 0.488 . . . . 29.47 110.085 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.2 t -76.85 102.97 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 110.098 -0.334 . . . . 31.36 110.098 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.8 mmtt -72.75 -44.07 62.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.31 -0.404 . . . . 48.76 110.037 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -147.41 150.63 35.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 56.32 110.444 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -147.89 124.86 11.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.354 -0.839 . . . . 36.21 109.42 -179.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -147.24 142.58 27.37 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.586 -0.446 . . . . 49.24 111.389 179.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt -57.74 146.26 31.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.758 -0.83 . . . . 40.1 108.758 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 29.4 mt -86.29 133.38 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 105.814 -1.921 . . . . 39.7 105.814 178.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -53.89 136.71 40.28 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.702 1.001 . . . . 61.36 113.702 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 66.92 31.42 7.14 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 114.583 1.327 . . . . 72.55 114.583 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 p -138.54 154.85 48.77 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.374 -1.713 . . . . 48.7 106.374 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -106.99 -24.15 12.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 68.4 111.795 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -113.55 -18.02 12.04 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 116.245 1.943 . . . . 53.37 116.245 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.7 mt -81.15 137.93 35.9 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 117.504 2.409 . . . . 39.43 117.504 -176.442 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.5 mt -132.68 131.06 59.74 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.394 -0.965 . . . . 30.74 108.394 177.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -95.06 131.25 41.26 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.609 -1.256 . . . . 51.4 107.609 178.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.7 mt -119.07 144.01 46.82 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.282 -0.417 . . . . 40.31 110.643 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 88.4 mt -113.72 110.73 33.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 1 N-CA-C 99.46 -4.274 . . . . 47.56 99.46 176.279 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 22.5 t -111.83 130.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 114.648 1.351 . . . . 25.96 114.648 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -95.65 113.7 25.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.055 -0.975 . . . . 53.78 109.595 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.17 20.1 17.36 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 111.894 0.331 . . . . 32.48 111.894 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.75 -76.17 1.08 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.671 -0.776 . . . . 41.22 113.732 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -81.92 -16.73 49.57 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.08 0.552 . . . . 64.38 111.851 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -151.11 166.43 30.81 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.483 0.658 . . . . 62.62 111.082 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -121.21 147.25 45.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.448 -2.427 . . . . 49.83 104.448 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 24.7 mtp180 -142.49 153.29 43.52 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 119.965 -0.694 . . . . 62.88 111.696 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 71.9 m -101.22 122.45 43.67 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.069 -1.826 . . . . 36.43 106.069 179.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 80.3 mt -130.24 128.97 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.72 -0.673 . . . . 35.5 112.703 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.7 t -99.24 137.39 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.428 -0.806 . . . . 32.11 110.978 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -134.02 144.0 48.44 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 105.71 -1.959 . . . . 32.91 105.71 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . -111.17 58.52 0.39 Allowed Glycine 0 C--O 1.224 -0.469 0 C-N-CA 119.786 -1.197 . . . . 33.43 114.561 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 pt -114.67 3.71 7.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 113.732 1.012 . . . . 29.96 113.732 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.85 -19.15 0.9 Allowed 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 117.443 2.386 . . . . 33.15 117.443 -177.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . 0.442 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 19.2 p-10 -80.6 -16.93 52.9 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.38 -0.6 . . . . 49.28 109.38 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -118.86 -33.81 4.11 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 113.288 0.848 . . . . 31.01 113.288 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 27.1 mm -124.43 110.41 28.43 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 112.205 0.446 . . . . 40.88 112.205 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -67.94 152.11 77.32 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 CA-C-O 120.988 0.328 . . . . 31.58 112.574 -179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 85.4 Cg_exo -51.27 -40.61 60.94 Favored 'Trans proline' 0 C--O 1.235 0.357 1 C-N-CA 125.758 4.305 . . . . 30.49 115.042 -179.81 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.2 pm0 -66.23 -13.15 59.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.736 1.013 . . . . 35.06 113.736 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.61 -6.41 59.36 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.325 -0.95 . . . . 45.96 111.351 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 mt -107.05 -37.66 6.24 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.211 0.448 . . . . 30.88 112.211 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -54.88 131.8 45.11 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.072 0.768 . . . . 49.18 113.072 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.76 -11.14 69.66 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.603 -0.726 . . . . 27.77 114.583 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -104.01 164.13 11.91 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.548 1.314 . . . . 42.38 114.548 -178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -104.06 142.76 33.9 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.0 -1.111 . . . . 27.74 108.0 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -145.24 171.82 14.0 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.564 0.54 . . . . 31.53 110.099 179.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 56.0 mt -89.21 135.38 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 107.247 -1.39 . . . . 21.92 107.247 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -136.18 138.11 41.6 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.46 -0.57 . . . . 24.63 109.46 179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 21.9 t -86.6 121.14 37.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 101.437 -3.542 . . . . 30.87 101.437 175.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 21.4 m -111.73 -0.8 9.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 120.598 3.555 . . . . 36.81 120.598 -176.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -114.86 39.98 2.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 119.558 -0.857 . . . . 39.29 111.501 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.24 164.54 12.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 43.03 109.815 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.82 124.19 87.96 Favored Pre-proline 0 C--O 1.238 0.45 0 N-CA-C 107.44 -1.318 . . . . 72.17 107.44 179.341 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -51.48 150.73 15.17 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.965 1.777 . . . . 60.13 110.817 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . 0.414 ' O ' ' N ' ' A' ' 82' ' ' SER . 33.3 mmtm -151.28 138.75 19.51 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.562 0.579 . . . . 70.92 112.562 -179.609 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 8.8 ptmt -100.76 124.79 46.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.788 -0.642 . . . . 78.72 111.964 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -116.94 119.15 34.45 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 106.639 -1.615 . . . . 58.03 106.639 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 m 52.73 45.82 27.95 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.15 -1.056 . . . . 58.22 108.15 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.47 8.85 76.92 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.584 0.994 . . . . 61.21 115.584 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' VAL . . . . . . . . . . . . . 26.2 t -107.74 126.0 64.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 117.489 0.645 . . . . 55.75 111.487 179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -77.57 113.46 15.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.428 -0.806 . . . . 69.15 110.295 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' SER . . . . . 0.414 ' N ' ' O ' ' A' ' 75' ' ' LYS . 29.2 t -98.3 120.85 39.42 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.509 -0.923 . . . . 43.35 108.509 178.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -104.47 33.03 3.71 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.237 0.828 . . . . 50.08 113.237 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . 168.34 -166.6 39.65 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.461 -0.876 . . . . 32.49 110.97 179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 64.2 ttp -155.76 127.94 7.63 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 113.531 0.938 . . . . 40.68 113.531 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 tp -70.68 125.33 26.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.434 -0.803 . . . . 23.18 111.453 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 39.6 mm -89.89 133.47 31.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 120.732 0.301 . . . . 22.54 110.22 178.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 1.3 pp -146.8 174.5 11.42 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.537 -0.302 . . . . 37.76 111.246 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -98.53 148.64 23.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.16 -1.422 . . . . 22.15 107.16 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -151.24 123.22 8.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 109.821 -0.437 . . . . 42.0 109.821 179.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.8 p -83.44 161.21 21.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.693 0.759 . . . . 34.87 109.901 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . 0.596 ' CD ' ' N ' ' A' ' 92' ' ' GLU . 2.4 mp0 -51.97 -27.05 12.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.695 -1.139 . . . . 64.69 113.415 -178.507 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.75 5.73 14.95 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.851 0.315 . . . . 53.66 111.851 179.667 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.14 -3.58 86.74 Favored Glycine 0 CA--C 1.53 1.022 0 N-CA-C 116.278 1.271 . . . . 41.55 116.278 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -73.01 129.19 37.53 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 118.9 -1.12 . . . . 34.96 110.579 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 2.5 t -101.18 144.33 13.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 36.21 111.906 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.36 134.83 42.19 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.507 0.323 . . . . 36.98 110.901 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 57.4 mt -72.51 152.19 42.04 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 118.809 -1.156 . . . . 27.2 108.902 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 92.0 mt -125.37 86.61 56.86 Favored Pre-proline 0 C--O 1.243 0.721 0 N-CA-C 103.997 -2.594 . . . . 21.25 103.997 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.42 152.04 48.72 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 116.522 -1.852 . . . . 21.54 110.919 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 66.3 t -91.69 143.09 27.41 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 105.034 -2.21 . . . . 22.7 105.034 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -53.72 148.32 36.9 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 CA-C-N 119.073 0.705 . . . . 26.67 110.728 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -29.9 67.91 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.422 0.897 . . . . 55.16 113.422 -178.188 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -62.96 -32.46 73.79 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.123 1.527 . . . . 48.12 115.123 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 58.2 t -65.83 119.35 60.11 Favored Pre-proline 0 N--CA 1.463 0.215 0 N-CA-C 114.297 1.221 . . . . 24.81 114.297 -177.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -61.26 140.51 89.04 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 120.063 0.509 . . . . 25.24 112.81 -179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.0 m -59.77 145.02 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 106.623 -1.621 . . . . 23.65 106.623 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 94.3 -16.73 60.4 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 119.21 -1.471 . . . . 23.13 112.738 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.06 143.4 32.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.019 0.909 . . . . 24.56 109.384 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -83.45 142.08 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 117.931 -1.507 . . . . 44.37 110.648 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.7 t -112.64 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 106.773 -1.566 . . . . 28.73 106.773 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' TRP . . . . . 0.479 ' OXT' ' CH2' ' A' ' 13' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.706 -0.664 . . . . 44.95 112.43 -177.763 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' MET . . . . . 0.555 ' HB2' ' O ' ' A' ' 149' ' ' HOH . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.14 0.495 . . . . 91.15 111.796 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 47.44 109.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 115.806 1.78 . . . . 68.45 115.806 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -117.37 132.88 56.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.918 -1.141 . . . . 49.99 107.918 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -108.85 170.33 8.11 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.996 1.11 . . . . 67.34 113.996 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -95.38 143.67 26.55 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.467 -0.788 . . . . 75.64 110.404 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 36.0 t -51.9 -43.7 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.843 1.053 . . . . 58.45 113.843 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.64 -30.99 69.11 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.6 -0.44 . . . . 61.43 109.996 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.766 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 26.9 tp10 -67.56 -41.14 84.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.979 -1.119 . . . . 63.0 107.979 179.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -64.41 -48.27 76.03 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 108.395 -0.965 . . . . 40.58 108.395 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' ' HB2' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -52.86 -19.03 2.23 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 115.372 1.619 . . . . 54.63 115.372 -178.833 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . 0.766 ' HG2' ' O ' ' A' ' 11' ' ' GLU . 56.9 pttt -72.66 -26.1 61.52 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 118.521 -1.272 . . . . 66.63 110.794 -179.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHE . . . . . 0.505 ' CE1' ' HE3' ' A' ' 14' ' ' LYS . 66.8 m-85 -79.72 142.85 35.08 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.427 -1.323 . . . . 43.87 107.427 178.311 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -115.72 117.56 30.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 114.144 1.164 . . . . 54.61 114.144 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' MET . . . . . 0.423 ' HA ' ' O ' ' A' ' 68' ' ' PHE . 64.9 mtm -113.08 136.12 53.05 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.509 -2.034 . . . . 28.49 105.509 178.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -137.52 158.5 44.26 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.146 -0.687 . . . . 47.49 109.146 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . 0.421 HG21 HG11 ' A' ' 105' ' ' VAL . 55.9 t -78.64 131.82 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 N-CA-C 106.651 -1.611 . . . . 23.62 106.651 178.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.64 143.61 15.3 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.269 -0.967 . . . . 27.26 112.019 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.8 tp -98.24 123.94 42.58 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.177 0.488 . . . . 29.47 110.085 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.2 t -76.85 102.97 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 110.098 -0.334 . . . . 31.36 110.098 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.8 mmtt -72.75 -44.07 62.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.31 -0.404 . . . . 48.76 110.037 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -147.41 150.63 35.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 56.32 110.444 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -147.89 124.86 11.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.354 -0.839 . . . . 36.21 109.42 -179.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -147.24 142.58 27.37 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.586 -0.446 . . . . 49.24 111.389 179.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt -57.74 146.26 31.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.758 -0.83 . . . . 40.1 108.758 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 29.4 mt -86.29 133.38 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 105.814 -1.921 . . . . 39.7 105.814 178.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -53.89 136.71 40.28 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.702 1.001 . . . . 61.36 113.702 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 66.92 31.42 7.14 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 114.583 1.327 . . . . 72.55 114.583 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 p -138.54 154.85 48.77 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.374 -1.713 . . . . 48.7 106.374 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -106.99 -24.15 12.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 68.4 111.795 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . 0.418 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 74.7 mttt -113.55 -18.02 12.04 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 116.245 1.943 . . . . 53.37 116.245 -178.219 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.7 mt -81.15 137.93 35.9 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 117.504 2.409 . . . . 39.43 117.504 -176.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.5 mt -132.68 131.06 59.74 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.394 -0.965 . . . . 30.74 108.394 177.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -95.06 131.25 41.26 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.609 -1.256 . . . . 51.4 107.609 178.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.7 mt -119.07 144.01 46.82 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.282 -0.417 . . . . 40.31 110.643 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 88.4 mt -113.72 110.73 33.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 1 N-CA-C 99.46 -4.274 . . . . 47.56 99.46 176.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 22.5 t -111.83 130.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 114.648 1.351 . . . . 25.96 114.648 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -95.65 113.7 25.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.055 -0.975 . . . . 53.78 109.595 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.17 20.1 17.36 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 111.894 0.331 . . . . 32.48 111.894 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.75 -76.17 1.08 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.671 -0.776 . . . . 41.22 113.732 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -81.92 -16.73 49.57 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.08 0.552 . . . . 64.38 111.851 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -151.11 166.43 30.81 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.483 0.658 . . . . 62.62 111.082 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -121.21 147.25 45.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.448 -2.427 . . . . 49.83 104.448 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . 0.492 ' NH1' ' HB ' ' A' ' 70' ' ' VAL . 24.7 mtp180 -142.49 153.29 43.52 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 119.965 -0.694 . . . . 62.88 111.696 179.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 71.9 m -101.22 122.45 43.67 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.069 -1.826 . . . . 36.43 106.069 179.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 80.3 mt -130.24 128.97 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.72 -0.673 . . . . 35.5 112.703 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.7 t -99.24 137.39 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.428 -0.806 . . . . 32.11 110.978 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -134.02 144.0 48.44 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 105.71 -1.959 . . . . 32.91 105.71 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' HA2' ' O ' ' A' ' 33' ' ' LYS . . . -111.17 58.52 0.39 Allowed Glycine 0 C--O 1.224 -0.469 0 C-N-CA 119.786 -1.197 . . . . 33.43 114.561 -178.433 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 pt -114.67 3.71 7.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 113.732 1.012 . . . . 29.96 113.732 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.85 -19.15 0.9 Allowed 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 117.443 2.386 . . . . 33.15 117.443 -177.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 19.2 p-10 -80.6 -16.93 52.9 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.38 -0.6 . . . . 49.28 109.38 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -118.86 -33.81 4.11 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 113.288 0.848 . . . . 31.01 113.288 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 27.1 mm -124.43 110.41 28.43 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 112.205 0.446 . . . . 40.88 112.205 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 67.3 Cg_endo -67.94 152.11 77.32 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 CA-C-O 120.988 0.328 . . . . 31.58 112.574 -179.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 85.4 Cg_exo -51.27 -40.61 60.94 Favored 'Trans proline' 0 C--O 1.235 0.357 1 C-N-CA 125.758 4.305 . . . . 30.49 115.042 -179.81 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.2 pm0 -66.23 -13.15 59.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.736 1.013 . . . . 35.06 113.736 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.61 -6.41 59.36 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.325 -0.95 . . . . 45.96 111.351 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 mt -107.05 -37.66 6.24 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.211 0.448 . . . . 30.88 112.211 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -54.88 131.8 45.11 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.072 0.768 . . . . 49.18 113.072 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.76 -11.14 69.66 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.603 -0.726 . . . . 27.77 114.583 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 66' ' ' PHE . 9.8 mmtm -104.01 164.13 11.91 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.548 1.314 . . . . 42.38 114.548 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -104.06 142.76 33.9 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.0 -1.111 . . . . 27.74 108.0 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PHE . . . . . 0.452 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 91.5 m-85 -145.24 171.82 14.0 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.564 0.54 . . . . 31.53 110.099 179.183 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 56.0 mt -89.21 135.38 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 107.247 -1.39 . . . . 21.92 107.247 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PHE . . . . . 0.423 ' O ' ' HA ' ' A' ' 17' ' ' MET . 92.1 m-85 -136.18 138.11 41.6 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.46 -0.57 . . . . 24.63 109.46 179.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . 0.514 ' CG2' HD11 ' A' ' 87' ' ' ILE . 21.9 t -86.6 121.14 37.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 101.437 -3.542 . . . . 30.87 101.437 175.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . 0.492 ' HB ' ' NH1' ' A' ' 46' ' ' ARG . 21.4 m -111.73 -0.8 9.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 120.598 3.555 . . . . 36.81 120.598 -176.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -114.86 39.98 2.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 119.558 -0.857 . . . . 39.29 111.501 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.24 164.54 12.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 43.03 109.815 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LYS . . . . . 0.503 ' HB2' ' NZ ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -66.82 124.19 87.96 Favored Pre-proline 0 C--O 1.238 0.45 0 N-CA-C 107.44 -1.318 . . . . 72.17 107.44 179.341 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -51.48 150.73 15.17 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.965 1.777 . . . . 60.13 110.817 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -151.28 138.75 19.51 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.562 0.579 . . . . 70.92 112.562 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . 0.639 ' HA ' ' O ' ' A' ' 80' ' ' VAL . 8.8 ptmt -100.76 124.79 46.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.788 -0.642 . . . . 78.72 111.964 -179.576 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -116.94 119.15 34.45 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 106.639 -1.615 . . . . 58.03 106.639 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 m 52.73 45.82 27.95 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.15 -1.056 . . . . 58.22 108.15 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.47 8.85 76.92 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.584 0.994 . . . . 61.21 115.584 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' VAL . . . . . 0.639 ' O ' ' HA ' ' A' ' 76' ' ' LYS . 26.2 t -107.74 126.0 64.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 117.489 0.645 . . . . 55.75 111.487 179.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -77.57 113.46 15.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.428 -0.806 . . . . 69.15 110.295 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.2 t -98.3 120.85 39.42 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.509 -0.923 . . . . 43.35 108.509 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -104.47 33.03 3.71 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.237 0.828 . . . . 50.08 113.237 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' A' ' 147' ' ' HOH . . . 168.34 -166.6 39.65 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.461 -0.876 . . . . 32.49 110.97 179.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 64.2 ttp -155.76 127.94 7.63 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 113.531 0.938 . . . . 40.68 113.531 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 tp -70.68 125.33 26.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.434 -0.803 . . . . 23.18 111.453 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ILE . . . . . 0.514 HD11 ' CG2' ' A' ' 69' ' ' VAL . 39.6 mm -89.89 133.47 31.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 120.732 0.301 . . . . 22.54 110.22 178.171 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . 0.465 HD22 HG13 ' A' ' 96' ' ' VAL . 1.3 pp -146.8 174.5 11.42 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.537 -0.302 . . . . 37.76 111.246 178.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -98.53 148.64 23.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.16 -1.422 . . . . 22.15 107.16 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -151.24 123.22 8.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 109.821 -0.437 . . . . 42.0 109.821 179.412 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.8 p -83.44 161.21 21.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.693 0.759 . . . . 34.87 109.901 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . 0.871 ' CD ' ' H ' ' A' ' 92' ' ' GLU . 2.4 mp0 -51.97 -27.05 12.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.695 -1.139 . . . . 64.69 113.415 -178.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.75 5.73 14.95 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.851 0.315 . . . . 53.66 111.851 179.667 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.14 -3.58 86.74 Favored Glycine 0 CA--C 1.53 1.022 0 N-CA-C 116.278 1.271 . . . . 41.55 116.278 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -73.01 129.19 37.53 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 118.9 -1.12 . . . . 34.96 110.579 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 HD22 ' A' ' 88' ' ' LEU . 2.5 t -101.18 144.33 13.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 36.21 111.906 -179.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.36 134.83 42.19 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.507 0.323 . . . . 36.98 110.901 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 57.4 mt -72.51 152.19 42.04 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 118.809 -1.156 . . . . 27.2 108.902 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 92.0 mt -125.37 86.61 56.86 Favored Pre-proline 0 C--O 1.243 0.721 0 N-CA-C 103.997 -2.594 . . . . 21.25 103.997 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.42 152.04 48.72 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 116.522 -1.852 . . . . 21.54 110.919 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 66.3 t -91.69 143.09 27.41 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 105.034 -2.21 . . . . 22.7 105.034 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -53.72 148.32 36.9 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 CA-C-N 119.073 0.705 . . . . 26.67 110.728 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -29.9 67.91 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.422 0.897 . . . . 55.16 113.422 -178.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -62.96 -32.46 73.79 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.123 1.527 . . . . 48.12 115.123 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . 0.421 HG11 HG21 ' A' ' 19' ' ' VAL . 58.2 t -65.83 119.35 60.11 Favored Pre-proline 0 N--CA 1.463 0.215 0 N-CA-C 114.297 1.221 . . . . 24.81 114.297 -177.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -61.26 140.51 89.04 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 120.063 0.509 . . . . 25.24 112.81 -179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.0 m -59.77 145.02 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 106.623 -1.621 . . . . 23.65 106.623 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 94.3 -16.73 60.4 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 119.21 -1.471 . . . . 23.13 112.738 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.06 143.4 32.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.019 0.909 . . . . 24.56 109.384 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -83.45 142.08 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 117.931 -1.507 . . . . 44.37 110.648 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.7 t -112.64 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 106.773 -1.566 . . . . 28.73 106.773 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' TRP . . . . . 0.681 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.706 -0.664 . . . . 44.95 112.43 -177.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . 0.48 ' O ' ' HA2' ' A' ' 84' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . 0.555 ' O ' ' HB2' ' A' ' 4' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' MET . . . . . 0.555 ' HB2' ' O ' ' A' ' 149' ' ' HOH . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.14 0.495 . . . . 91.150000000000006 111.796 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 47.44 109.76 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 115.806 1.78 . . . . 68.450000000000003 115.806 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -117.37 132.88 56.5 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 107.918 -1.141 . . . . 49.990000000000002 107.918 177.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -108.85 170.33 8.11 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 113.996 1.11 . . . . 67.340000000000003 113.996 -178.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -95.38 143.67 26.55 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.467 -0.788 . . . . 75.640000000000001 110.404 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 36.0 t -51.9 -43.7 36.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 N-CA-C 113.843 1.053 . . . . 58.450000000000003 113.843 -179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -59.64 -30.99 69.11 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 120.6 -0.44 . . . . 61.43 109.996 -179.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.766 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 26.9 tp10 -67.56 -41.14 84.7 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 107.979 -1.119 . . . . 63.0 107.979 179.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -64.41 -48.27 76.03 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 108.395 -0.965 . . . . 40.579999999999998 108.395 179.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TRP . . . . . 0.681 ' CZ3' ' HB2' ' A' ' 112' ' ' TRP . 0.2 OUTLIER -52.86 -19.03 2.23 Favored 'General case' 0 CA--C 1.527 0.084 0 N-CA-C 115.372 1.619 . . . . 54.630000000000003 115.372 -178.833 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.766 ' HG2' ' O ' ' A' ' 11' ' ' GLU . 56.9 pttt -72.66 -26.1 61.52 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 118.521 -1.272 . . . . 66.629999999999995 110.794 -179.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHE . . . . . 0.505 ' CE1' ' HE3' ' A' ' 14' ' ' LYS . 66.8 m-85 -79.72 142.85 35.08 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 107.427 -1.323 . . . . 43.869999999999997 107.427 178.311 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -115.72 117.56 30.59 Favored 'General case' 0 CA--C 1.502 -0.869 0 N-CA-C 114.144 1.164 . . . . 54.609999999999999 114.144 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' MET . . . . . 0.423 ' HA ' ' O ' ' A' ' 68' ' ' PHE . 64.9 mtm -113.08 136.12 53.05 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 105.509 -2.034 . . . . 28.489999999999998 105.509 178.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -137.52 158.5 44.26 Favored 'General case' 0 N--CA 1.444 -0.747 0 N-CA-C 109.146 -0.687 . . . . 47.490000000000002 109.146 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.421 HG21 HG11 ' A' ' 105' ' ' VAL . 55.9 t -78.64 131.82 33.62 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.965 0 N-CA-C 106.651 -1.611 . . . . 23.620000000000001 106.651 178.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . -132.64 143.61 15.3 Favored Glycine 0 C--N 1.332 0.33 0 C-N-CA 120.269 -0.967 . . . . 27.260000000000002 112.019 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 21.8 tp -98.24 123.94 42.58 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.177 0.488 . . . . 29.469999999999999 110.085 179.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 84.2 t -76.85 102.97 3.77 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.482 0 N-CA-C 110.098 -0.334 . . . . 31.359999999999999 110.098 179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 38.8 mmtt -72.75 -44.07 62.1 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.31 -0.404 . . . . 48.759999999999998 110.037 -179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.6 tttt -147.41 150.63 35.03 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.943 -0.571 . . . . 56.32 110.444 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -147.89 124.86 11.32 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.354 -0.839 . . . . 36.210000000000001 109.42 -179.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -147.24 142.58 27.37 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.586 -0.446 . . . . 49.240000000000002 111.389 179.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.4 mtpt -57.74 146.26 31.84 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 108.758 -0.83 . . . . 40.100000000000001 108.758 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 29.4 mt -86.29 133.38 29.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 N-CA-C 105.814 -1.921 . . . . 39.700000000000003 105.814 178.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LYS . . . . . . . . . . . . . 14.7 ttpt -53.89 136.71 40.28 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 113.702 1.001 . . . . 61.359999999999999 113.702 -178.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 37.7 mtm180 66.92 31.42 7.14 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 114.583 1.327 . . . . 72.549999999999997 114.583 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 p -138.54 154.85 48.77 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 106.374 -1.713 . . . . 48.700000000000003 106.374 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 91.6 mttt -106.99 -24.15 12.09 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.197 -0.456 . . . . 68.400000000000006 111.795 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . 0.418 ' O ' ' HA2' ' A' ' 51' ' ' GLY . 74.7 mttt -113.55 -18.02 12.04 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 116.245 1.943 . . . . 53.369999999999997 116.245 -178.219 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 17.7 mt -81.15 137.93 35.9 Favored 'General case' 0 CA--C 1.512 -0.519 0 N-CA-C 117.504 2.409 . . . . 39.43 117.504 -176.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 53.5 mt -132.68 131.06 59.74 Favored 'Isoleucine or valine' 0 C--O 1.241 0.657 0 N-CA-C 108.394 -0.965 . . . . 30.739999999999998 108.394 177.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -95.06 131.25 41.26 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 107.609 -1.256 . . . . 51.399999999999999 107.609 178.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 15.7 mt -119.07 144.01 46.82 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.282 -0.417 . . . . 40.310000000000002 110.643 179.897 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 88.4 mt -113.72 110.73 33.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.635 1 N-CA-C 99.46 -4.274 . . . . 47.560000000000002 99.46 176.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 22.5 t -111.83 130.62 65.12 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.451 0 N-CA-C 114.648 1.351 . . . . 25.960000000000001 114.648 -176.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -95.65 113.7 25.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.055 -0.975 . . . . 53.780000000000001 109.595 179.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -102.17 20.1 17.36 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 111.894 0.331 . . . . 32.479999999999997 111.894 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . 93.75 -76.17 1.08 Allowed Glycine 0 N--CA 1.453 -0.222 0 C-N-CA 120.671 -0.776 . . . . 41.219999999999999 113.732 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 15.3 p-10 -81.92 -16.73 49.57 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 123.08 0.552 . . . . 64.379999999999995 111.851 -179.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 21.7 pt-20 -151.11 166.43 30.81 Favored 'General case' 0 N--CA 1.448 -0.526 0 CA-C-O 121.483 0.658 . . . . 62.619999999999997 111.082 -179.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -121.21 147.25 45.87 Favored 'General case' 0 N--CA 1.444 -0.76 0 N-CA-C 104.448 -2.427 . . . . 49.829999999999998 104.448 178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.492 ' NH1' ' HB ' ' A' ' 70' ' ' VAL . 24.7 mtp180 -142.49 153.29 43.52 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 119.965 -0.694 . . . . 62.880000000000003 111.696 179.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 71.9 m -101.22 122.45 43.67 Favored 'General case' 0 CA--C 1.504 -0.79 0 N-CA-C 106.069 -1.826 . . . . 36.43 106.069 179.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 80.3 mt -130.24 128.97 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 CA-C-N 115.72 -0.673 . . . . 35.5 112.703 -178.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 68.7 t -99.24 137.39 26.83 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.472 0 CA-C-N 115.428 -0.806 . . . . 32.109999999999999 110.978 179.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 10.0 t -134.02 144.0 48.44 Favored 'General case' 0 N--CA 1.465 0.299 0 N-CA-C 105.71 -1.959 . . . . 32.909999999999997 105.71 177.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . 0.418 ' HA2' ' O ' ' A' ' 33' ' ' LYS . . . -111.17 58.52 0.39 Allowed Glycine 0 C--O 1.224 -0.469 0 C-N-CA 119.786 -1.197 . . . . 33.43 114.561 -178.433 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 6.5 pt -114.67 3.71 7.85 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.438 0 N-CA-C 113.732 1.012 . . . . 29.960000000000001 113.732 -178.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -50.85 -19.15 0.9 Allowed 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 117.443 2.386 . . . . 33.149999999999999 117.443 -177.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.404 ' OD1' ' N ' ' A' ' 54' ' ' ASP . 19.2 p-10 -80.6 -16.93 52.9 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.38 -0.6 . . . . 49.280000000000001 109.38 179.607 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -118.86 -33.81 4.11 Favored 'General case' 0 C--O 1.22 -0.499 0 N-CA-C 113.288 0.848 . . . . 31.010000000000002 113.288 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 27.1 mm -124.43 110.41 28.43 Favored Pre-proline 0 C--N 1.33 -0.243 0 N-CA-C 112.205 0.446 . . . . 40.880000000000003 112.205 -177.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 58' ' ' PRO . 67.3 Cg_endo -67.94 152.11 77.32 Favored 'Trans proline' 0 CA--C 1.531 0.335 0 CA-C-O 120.988 0.328 . . . . 31.579999999999998 112.574 -179.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 57' ' ' PRO . 85.4 Cg_exo -51.27 -40.61 60.94 Favored 'Trans proline' 0 C--O 1.235 0.357 1 C-N-CA 125.758 4.305 . . . . 30.489999999999998 115.042 -179.81 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 25.2 pm0 -66.23 -13.15 59.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.736 1.013 . . . . 35.060000000000002 113.736 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -84.61 -6.41 59.36 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 119.325 -0.95 . . . . 45.960000000000001 111.351 178.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 mt -107.05 -37.66 6.24 Favored 'General case' 0 N--CA 1.47 0.572 0 N-CA-C 112.211 0.448 . . . . 30.879999999999999 112.211 -179.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -54.88 131.8 45.11 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.072 0.768 . . . . 49.18 113.072 179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.76 -11.14 69.66 Favored Glycine 0 N--CA 1.443 -0.848 0 CA-C-N 115.603 -0.726 . . . . 27.77 114.583 179.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 66' ' ' PHE . 9.8 mmtm -104.01 164.13 11.91 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 114.548 1.314 . . . . 42.380000000000003 114.548 -178.997 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 99.6 mttt -104.06 142.76 33.9 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 108.0 -1.111 . . . . 27.739999999999998 108.0 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.452 ' CE1' ' HB2' ' A' ' 64' ' ' LYS . 91.5 m-85 -145.24 171.82 14.0 Favored 'General case' 0 C--O 1.237 0.395 0 O-C-N 123.564 0.54 . . . . 31.530000000000001 110.099 179.183 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 56.0 mt -89.21 135.38 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 107.247 -1.39 . . . . 21.920000000000002 107.247 178.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PHE . . . . . 0.423 ' O ' ' HA ' ' A' ' 17' ' ' MET . 92.1 m-85 -136.18 138.11 41.6 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 109.46 -0.57 . . . . 24.629999999999999 109.46 179.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.514 ' CG2' HD11 ' A' ' 87' ' ' ILE . 21.9 t -86.6 121.14 37.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.376 0 N-CA-C 101.437 -3.542 . . . . 30.870000000000001 101.437 175.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . 0.492 ' HB ' ' NH1' ' A' ' 46' ' ' ARG . 21.4 m -111.73 -0.8 9.57 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 N-CA-C 120.598 3.555 . . . . 36.810000000000002 120.598 -176.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -114.86 39.98 2.73 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 119.558 -0.857 . . . . 39.289999999999999 111.501 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 34.8 mt -97.24 164.54 12.44 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.01 -0.541 . . . . 43.030000000000001 109.815 178.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.503 ' HB2' ' NZ ' ' A' ' 73' ' ' LYS . 0.0 OUTLIER -66.82 124.19 87.96 Favored Pre-proline 0 C--O 1.238 0.45 0 N-CA-C 107.44 -1.318 . . . . 72.170000000000002 107.44 179.341 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -51.48 150.73 15.17 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 121.965 1.777 . . . . 60.130000000000003 110.817 -179.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 33.3 mmtm -151.28 138.75 19.51 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.562 0.579 . . . . 70.920000000000002 112.562 -179.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . 0.639 ' HA ' ' O ' ' A' ' 80' ' ' VAL . 8.8 ptmt -100.76 124.79 46.91 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.788 -0.642 . . . . 78.719999999999999 111.964 -179.576 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -116.94 119.15 34.45 Favored 'General case' 0 CA--C 1.511 -0.542 0 N-CA-C 106.639 -1.615 . . . . 58.030000000000001 106.639 179.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 41.3 m 52.73 45.82 27.95 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.15 -1.056 . . . . 58.219999999999999 108.15 -179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 73.47 8.85 76.92 Favored Glycine 0 N--CA 1.449 -0.449 0 N-CA-C 115.584 0.994 . . . . 61.210000000000001 115.584 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' VAL . . . . . 0.639 ' O ' ' HA ' ' A' ' 76' ' ' LYS . 26.2 t -107.74 126.0 64.16 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 CA-C-N 117.489 0.645 . . . . 55.75 111.487 179.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 4.9 tp10 -77.57 113.46 15.42 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.428 -0.806 . . . . 69.150000000000006 110.295 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 29.2 t -98.3 120.85 39.42 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 108.509 -0.923 . . . . 43.350000000000001 108.509 178.76 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 43.1 mt-30 -104.47 33.03 3.71 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 113.237 0.828 . . . . 50.079999999999998 113.237 -178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . 0.48 ' HA2' ' O ' ' A' ' 147' ' ' HOH . . . 168.34 -166.6 39.65 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.461 -0.876 . . . . 32.490000000000002 110.97 179.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' MET . . . . . . . . . . . . . 64.2 ttp -155.76 127.94 7.63 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 113.531 0.938 . . . . 40.68 113.531 -179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 61.3 tp -70.68 125.33 26.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.434 -0.803 . . . . 23.18 111.453 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.514 HD11 ' CG2' ' A' ' 69' ' ' VAL . 39.6 mm -89.89 133.47 31.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-O 120.732 0.301 . . . . 22.539999999999999 110.22 178.171 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.465 HD22 HG13 ' A' ' 96' ' ' VAL . 1.3 pp -146.8 174.5 11.42 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 116.537 -0.302 . . . . 37.759999999999998 111.246 178.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -98.53 148.64 23.56 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 107.16 -1.422 . . . . 22.149999999999999 107.16 178.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -151.24 123.22 8.14 Favored 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 109.821 -0.437 . . . . 42.0 109.821 179.412 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 15.8 p -83.44 161.21 21.38 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.693 0.759 . . . . 34.869999999999997 109.901 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . 0.871 ' H ' ' CD ' ' A' ' 92' ' ' GLU . 2.4 mp0 -51.97 -27.05 12.01 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 114.695 -1.139 . . . . 64.689999999999998 113.415 -178.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -80.75 5.73 14.95 Favored 'General case' 0 C--N 1.331 -0.21 0 N-CA-C 111.851 0.315 . . . . 53.659999999999997 111.851 179.667 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.14 -3.58 86.74 Favored Glycine 0 CA--C 1.53 1.022 0 N-CA-C 116.278 1.271 . . . . 41.549999999999997 116.278 179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -73.01 129.19 37.53 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 118.9 -1.12 . . . . 34.960000000000001 110.579 179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . 0.465 HG13 HD22 ' A' ' 88' ' ' LEU . 2.5 t -101.18 144.33 13.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.422 0 CA-C-N 116.034 -0.53 . . . . 36.210000000000001 111.906 -179.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . . . . . . . . . 72.6 m-85 -134.36 134.83 42.19 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.507 0.323 . . . . 36.979999999999997 110.901 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LEU . . . . . . . . . . . . . 57.4 mt -72.51 152.19 42.04 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 118.809 -1.156 . . . . 27.199999999999999 108.902 178.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 92.0 mt -125.37 86.61 56.86 Favored Pre-proline 0 C--O 1.243 0.721 0 N-CA-C 103.997 -2.594 . . . . 21.25 103.997 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -73.42 152.04 48.72 Favored 'Trans proline' 0 CA--C 1.536 0.597 0 C-N-CA 116.522 -1.852 . . . . 21.539999999999999 110.919 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 66.3 t -91.69 143.09 27.41 Favored Pre-proline 0 CA--C 1.546 0.812 0 N-CA-C 105.034 -2.21 . . . . 22.699999999999999 105.034 177.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -53.72 148.32 36.9 Favored 'Trans proline' 0 CA--C 1.542 0.9 0 CA-C-N 119.073 0.705 . . . . 26.670000000000002 110.728 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.27 -29.9 67.91 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 113.422 0.897 . . . . 55.159999999999997 113.422 -178.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -62.96 -32.46 73.79 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 115.123 1.527 . . . . 48.119999999999997 115.123 -179.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.421 HG11 HG21 ' A' ' 19' ' ' VAL . 58.2 t -65.83 119.35 60.11 Favored Pre-proline 0 N--CA 1.463 0.215 0 N-CA-C 114.297 1.221 . . . . 24.809999999999999 114.297 -177.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_exo -61.26 140.51 89.04 Favored 'Trans proline' 0 CA--C 1.541 0.84 0 C-N-CA 120.063 0.509 . . . . 25.239999999999998 112.81 -179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 29.0 m -59.77 145.02 12.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 N-CA-C 106.623 -1.621 . . . . 23.649999999999999 106.623 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 94.3 -16.73 60.4 Favored Glycine 0 CA--C 1.526 0.748 0 C-N-CA 119.21 -1.471 . . . . 23.129999999999999 112.738 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -56.06 143.4 32.82 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 118.019 0.909 . . . . 24.559999999999999 109.384 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ARG . . . . . . . . . . . . . 73.4 ttt180 -83.45 142.08 31.22 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 117.931 -1.507 . . . . 44.369999999999997 110.648 179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' VAL . . . . . . . . . . . . . 53.7 t -112.64 116.07 51.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 N-CA-C 106.773 -1.566 . . . . 28.73 106.773 179.555 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' TRP . . . . . 0.681 ' HB2' ' CZ3' ' A' ' 13' ' ' TRP . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.706 -0.664 . . . . 44.950000000000003 112.43 -177.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . 0.48 ' O ' ' HA2' ' A' ' 84' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . 0.555 ' O ' ' HB2' ' A' ' 4' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_